2RZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| N19 | C18 | doub | 1.30Å | 1.30Å | |
| N11 | C13 | sing | 1.47Å | 1.48Å | |
| N11 | C9 | sing | 1.35Å | 1.36Å | |
| C4 | C6 | sing | 1.51Å | 1.51Å | |
| C4 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.55Å | |
| C7 | C9 | sing | 1.51Å | 1.52Å | |
| C7 | N8 | sing | 1.47Å | 1.46Å | |
| C13 | C14 | sing | 1.51Å | 1.51Å | |
| C18 | N8 | sing | 1.37Å | 1.39Å | |
| C18 | N20 | sing | 1.38Å | 1.38Å | |
| C17 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C34 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | O10 | doub | 1.21Å | 1.23Å | |
| C29 | O28 | sing | 1.43Å | 1.43Å | |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C34 | C35 | doub | 1.39Å | 1.40Å | Aromatic |
| N20 | C32 | sing | 1.35Å | 1.35Å | |
| C15 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| O28 | C23 | sing | 1.36Å | 1.37Å | |
| C35 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C35 | O36 | sing | 1.36Å | 1.38Å | |
| C32 | O33 | doub | 1.21Å | 1.21Å | |
| C32 | C31 | sing | 1.51Å | 1.51Å | |
| C39 | O36 | sing | 1.43Å | 1.44Å | |
| C24 | C23 | doub | 1.39Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | O37 | sing | 1.36Å | 1.37Å | |
| C23 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | C25 | sing | 1.51Å | 1.51Å | |
| C25 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
| O37 | C38 | sing | 1.43Å | 1.44Å | |
| C22 | O27 | sing | 1.36Å | 1.37Å | |
| C22 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
| O27 | C30 | sing | 1.43Å | 1.44Å | |
| C26 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| C30 | H12 | sing | 1.09Å | 1.10Å | |
| C30 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C34 | H16 | sing | 1.08Å | 1.08Å | |
| C5 | H17 | sing | 1.08Å | 1.08Å | |
| C6 | H18 | sing | 1.09Å | 1.10Å | |
| C6 | H19 | sing | 1.09Å | 1.10Å | |
| N8 | H20 | sing | 0.97Å | 1.00Å | |
| N11 | H21 | sing | 0.97Å | 1.00Å | |
| C17 | H22 | sing | 1.08Å | 1.08Å | |
| N19 | H23 | sing | 0.97Å | 1.00Å | |
| N20 | H24 | sing | 0.97Å | 1.00Å | |
| C26 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C38 | H29 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| C38 | H31 | sing | 1.09Å | 1.10Å | |
| C39 | H32 | sing | 1.09Å | 1.10Å | |
| C39 | H33 | sing | 1.09Å | 1.10Å | |
| C39 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C2 | C1 | 120.5° | 120.0° |
| C2 | C3 | C4 | 118.8° | 120.0° |
| C3 | C2 | H2 | 119.7° | 120.0° |
| C2 | C3 | H3 | 120.6° | 120.0° |
| C2 | C1 | C5 | 120.4° | 120.0° |
| C2 | C1 | H1 | 119.8° | 120.0° |
| C1 | C2 | H2 | 119.7° | 120.0° |
| C3 | C4 | C6 | 120.7° | 120.1° |
| C3 | C4 | C12 | 120.8° | 120.0° |
| C4 | C3 | H3 | 120.6° | 120.0° |
| C1 | C5 | C12 | 119.4° | 120.0° |
| C5 | C1 | H1 | 119.8° | 120.0° |
| C1 | C5 | H17 | 120.3° | 120.0° |
| N19 | C18 | N8 | 122.3° | 120.0° |
| N19 | C18 | N20 | 117.4° | 119.9° |
| C18 | N19 | H23 | 112.0° | 120.0° |
| C13 | N11 | C9 | 125.2° | 120.0° |
| N11 | C13 | C14 | 113.4° | 109.5° |
| N11 | C13 | H6 | 108.5° | 109.4° |
| N11 | C13 | H7 | 108.5° | 109.5° |
| C13 | N11 | H21 | 117.4° | 120.0° |
| N11 | C9 | C7 | 118.9° | 120.0° |
| N11 | C9 | O10 | 122.1° | 120.1° |
| C9 | N11 | H21 | 117.4° | 120.0° |
| C6 | C4 | C12 | 118.4° | 120.0° |
| C4 | C6 | C7 | 110.9° | 109.5° |
| C4 | C6 | H18 | 109.1° | 109.4° |
| C4 | C6 | H19 | 109.1° | 109.5° |
| C4 | C12 | C5 | 120.0° | 120.0° |
| C4 | C12 | H5 | 120.0° | 120.0° |
| C5 | C12 | H5 | 120.0° | 120.0° |
| C12 | C5 | H17 | 120.3° | 120.0° |
| C6 | C7 | C9 | 113.1° | 109.4° |
| C6 | C7 | N8 | 105.6° | 109.4° |
| C6 | C7 | H4 | 111.2° | 109.5° |
| C7 | C6 | H18 | 109.1° | 109.4° |
| C7 | C6 | H19 | 109.1° | 109.5° |
| C9 | C7 | N8 | 102.3° | 109.5° |
| C7 | C9 | O10 | 118.8° | 120.0° |
| C9 | C7 | H4 | 111.6° | 109.5° |
| C7 | N8 | C18 | 126.0° | 120.0° |
| N8 | C7 | H4 | 112.6° | 109.5° |
| C7 | N8 | H20 | 117.0° | 119.9° |
| C13 | C14 | C17 | 120.7° | 120.0° |
| C13 | C14 | C15 | 119.3° | 119.9° |
| C14 | C13 | H6 | 108.5° | 109.5° |
| C14 | C13 | H7 | 108.5° | 109.5° |
| N8 | C18 | N20 | 120.2° | 120.0° |
| C18 | N8 | H20 | 117.0° | 120.0° |
| C18 | N20 | C32 | 128.2° | 120.0° |
| C18 | N20 | H24 | 115.9° | 120.0° |
| C14 | C17 | C34 | 119.6° | 120.1° |
| C17 | C14 | C15 | 120.0° | 120.1° |
| C14 | C17 | H22 | 120.2° | 119.9° |
| C17 | C34 | C35 | 121.0° | 120.0° |
| C17 | C34 | H16 | 119.5° | 120.0° |
| C34 | C17 | H22 | 120.2° | 119.9° |
| C29 | O28 | C23 | 123.8° | 117.0° |
| O28 | C29 | H26 | 109.5° | 109.5° |
| O28 | C29 | H27 | 109.5° | 109.4° |
| O28 | C29 | H28 | 109.5° | 109.5° |
| C14 | C15 | C16 | 120.5° | 120.0° |
| C14 | C15 | H8 | 119.7° | 120.0° |
| C34 | C35 | C16 | 119.2° | 119.9° |
| C34 | C35 | O36 | 121.7° | 120.1° |
| C35 | C34 | H16 | 119.5° | 120.0° |
| N20 | C32 | O33 | 121.9° | 120.0° |
| N20 | C32 | C31 | 118.4° | 120.0° |
| C32 | N20 | H24 | 115.9° | 120.0° |
| C15 | C16 | C35 | 119.5° | 119.8° |
| C15 | C16 | O37 | 121.9° | 120.1° |
| C16 | C15 | H8 | 119.7° | 120.0° |
| O28 | C23 | C24 | 124.0° | 120.1° |
| O28 | C23 | C22 | 116.7° | 120.1° |
| C16 | C35 | O36 | 119.2° | 120.0° |
| C35 | C16 | O37 | 118.6° | 120.1° |
| C35 | O36 | C39 | 120.3° | 117.0° |
| O33 | C32 | C31 | 119.7° | 120.0° |
| C32 | C31 | C25 | 108.5° | 109.4° |
| C32 | C31 | H14 | 109.7° | 109.5° |
| C32 | C31 | H15 | 109.7° | 109.4° |
| O36 | C39 | H32 | 109.5° | 109.5° |
| O36 | C39 | H33 | 109.4° | 109.5° |
| O36 | C39 | H34 | 109.5° | 109.5° |
| C23 | C24 | C25 | 120.3° | 120.0° |
| C24 | C23 | C22 | 119.3° | 119.8° |
| C23 | C24 | H10 | 119.8° | 120.0° |
| C24 | C25 | C31 | 120.0° | 119.9° |
| C24 | C25 | C26 | 120.6° | 120.1° |
| C25 | C24 | H10 | 119.9° | 120.0° |
| C16 | O37 | C38 | 120.4° | 117.0° |
| C23 | C22 | O27 | 116.7° | 120.1° |
| C23 | C22 | C21 | 120.2° | 119.9° |
| C31 | C25 | C26 | 119.4° | 119.9° |
| C25 | C31 | H14 | 109.7° | 109.5° |
| C25 | C31 | H15 | 109.7° | 109.5° |
| C25 | C26 | C21 | 119.3° | 120.1° |
| C25 | C26 | H25 | 120.4° | 119.9° |
| O37 | C38 | H29 | 109.5° | 109.5° |
| O37 | C38 | H30 | 109.5° | 109.5° |
| O37 | C38 | H31 | 109.5° | 109.5° |
| O27 | C22 | C21 | 123.0° | 120.1° |
| C22 | O27 | C30 | 120.4° | 117.0° |
| C22 | C21 | C26 | 120.3° | 120.0° |
| C22 | C21 | H9 | 119.9° | 120.0° |
| O27 | C30 | H11 | 109.5° | 109.5° |
| O27 | C30 | H12 | 109.5° | 109.5° |
| O27 | C30 | H13 | 109.5° | 109.5° |
| C26 | C21 | H9 | 119.9° | 120.0° |
| C21 | C26 | H25 | 120.3° | 120.0° |
| H6 | C13 | H7 | 109.5° | 109.4° |
| H11 | C30 | H12 | 109.5° | 109.5° |
| H11 | C30 | H13 | 109.5° | 109.5° |
| H12 | C30 | H13 | 109.5° | 109.4° |
| H14 | C31 | H15 | 109.5° | 109.5° |
| H18 | C6 | H19 | 109.5° | 109.5° |
| H26 | C29 | H27 | 109.4° | 109.5° |
| H26 | C29 | H28 | 109.4° | 109.5° |
| H27 | C29 | H28 | 109.5° | 109.5° |
| H29 | C38 | H30 | 109.5° | 109.4° |
| H29 | C38 | H31 | 109.4° | 109.5° |
| H30 | C38 | H31 | 109.4° | 109.4° |
| H32 | C39 | H33 | 109.5° | 109.4° |
| H32 | C39 | H34 | 109.4° | 109.4° |
| H33 | C39 | H34 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C2 | C1 | H2 | 180.0° | 180.0° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C3 | C2 | C1 | C5 | 0.8° | 0.0° |
| C2 | C3 | C4 | C6 | 179.8° | 180.0° |
| C2 | C3 | C4 | C12 | 3.5° | 0.0° |
| C3 | C2 | C1 | H1 | 179.2° | 179.7° |
| C1 | C2 | C3 | C4 | 2.5° | 0.0° |
| C2 | C1 | C5 | H1 | 180.0° | 179.8° |
| C2 | C1 | C5 | C12 | 0.1° | 0.1° |
| C1 | C2 | C3 | H3 | 177.5° | 180.0° |
| C2 | C1 | C5 | H17 | 179.9° | 179.8° |
| C3 | C4 | C6 | C12 | 176.3° | 180.0° |
| C3 | C4 | C12 | C5 | 2.9° | 0.1° |
| C3 | C4 | C6 | C7 | 72.5° | 89.9° |
| C4 | C3 | C2 | H2 | 177.5° | 180.0° |
| C3 | C4 | C12 | H5 | 177.1° | 180.0° |
| C3 | C4 | C6 | H18 | 47.7° | 30.0° |
| C3 | C4 | C6 | H19 | 167.3° | 150.0° |
| C1 | C5 | C12 | C4 | 1.1° | 0.1° |
| C1 | C5 | C12 | H17 | 180.0° | 179.7° |
| C5 | C1 | C2 | H2 | 179.2° | 180.0° |
| C1 | C5 | C12 | H5 | 178.9° | 180.0° |
| N19 | C18 | N8 | C7 | 8.9° | 5.4° |
| N19 | C18 | N8 | N20 | 177.2° | 180.0° |
| N19 | C18 | N20 | C32 | 174.9° | 173.7° |
| N19 | C18 | N8 | H20 | 171.1° | 174.6° |
| N19 | C18 | N20 | H24 | 5.1° | 6.2° |
| C13 | N11 | C9 | H21 | 180.0° | 179.9° |
| C13 | N11 | C9 | C7 | 176.0° | 179.9° |
| N11 | C13 | C14 | H6 | 120.6° | 120.0° |
| N11 | C13 | C14 | H7 | 120.6° | 120.0° |
| N11 | C13 | C14 | C17 | 44.5° | 90.2° |
| C13 | N11 | C9 | O10 | 1.3° | 0.0° |
| N11 | C13 | C14 | C15 | 137.7° | 90.0° |
| N11 | C13 | H6 | H7 | 118.2° | 119.9° |
| N11 | C9 | C7 | C6 | 126.3° | 60.1° |
| N11 | C9 | C7 | O10 | 174.9° | 179.9° |
| N11 | C9 | C7 | N8 | 120.5° | 180.0° |
| C9 | N11 | C13 | C14 | 58.3° | 180.0° |
| N11 | C9 | C7 | H4 | 0.0° | 60.0° |
| C9 | N11 | C13 | H6 | 178.9° | 60.0° |
| C9 | N11 | C13 | H7 | 62.3° | 59.9° |
| C6 | C4 | C12 | C5 | 179.2° | 179.9° |
| C4 | C6 | C7 | H18 | 120.2° | 119.9° |
| C4 | C6 | C7 | H19 | 120.2° | 120.1° |
| C4 | C6 | C7 | C9 | 69.5° | 175.0° |
| C4 | C6 | C7 | N8 | 179.4° | 65.1° |
| C6 | C4 | C3 | H3 | 0.2° | 0.0° |
| C4 | C6 | C7 | H4 | 56.9° | 54.9° |
| C6 | C4 | C12 | H5 | 0.8° | 0.0° |
| C4 | C6 | H18 | H19 | 119.4° | 120.0° |
| C4 | C12 | C5 | H5 | 180.0° | 179.9° |
| C12 | C4 | C6 | C7 | 103.8° | 90.1° |
| C12 | C4 | C3 | H3 | 176.5° | 180.0° |
| C4 | C12 | C5 | H17 | 178.9° | 179.8° |
| C12 | C4 | C6 | H18 | 136.0° | 150.0° |
| C12 | C4 | C6 | H19 | 16.4° | 30.0° |
| C12 | C5 | C1 | H1 | 179.9° | 179.7° |
| C6 | C7 | C9 | N8 | 113.2° | 119.9° |
| C6 | C7 | C9 | H4 | 126.3° | 120.0° |
| C6 | C7 | N8 | H4 | 121.5° | 120.0° |
| C6 | C7 | N8 | C18 | 81.6° | 85.0° |
| C6 | C7 | C9 | O10 | 58.8° | 120.0° |
| C7 | C6 | H18 | H19 | 119.3° | 120.1° |
| C6 | C7 | N8 | H20 | 98.4° | 95.0° |
| C9 | C7 | N8 | H4 | 119.9° | 120.1° |
| C9 | C7 | N8 | C18 | 159.8° | 155.0° |
| C9 | C7 | C6 | H18 | 170.3° | 55.1° |
| C9 | C7 | C6 | H19 | 50.7° | 64.9° |
| C9 | C7 | N8 | H20 | 20.2° | 24.9° |
| C7 | C9 | N11 | H21 | 4.0° | 0.0° |
| C7 | N8 | C18 | H20 | 180.0° | 180.0° |
| C7 | N8 | C18 | N20 | 173.9° | 174.5° |
| N8 | C7 | C9 | O10 | 54.4° | 0.1° |
| N8 | C7 | C6 | H18 | 59.2° | 175.0° |
| N8 | C7 | C6 | H19 | 60.4° | 55.0° |
| C13 | C14 | C17 | C15 | 177.8° | 179.8° |
| C13 | C14 | C17 | C34 | 177.8° | 179.7° |
| C13 | C14 | C15 | C16 | 178.9° | 180.0° |
| C14 | C13 | H6 | H7 | 118.2° | 120.0° |
| C13 | C14 | C15 | H8 | 1.2° | 0.0° |
| C14 | C13 | N11 | H21 | 121.7° | 0.1° |
| C13 | C14 | C17 | H22 | 2.2° | 0.0° |
| N8 | C18 | N20 | C32 | 2.3° | 6.2° |
| C18 | N8 | C7 | H4 | 40.0° | 35.0° |
| N8 | C18 | N19 | H23 | 177.3° | 175.0° |
| N8 | C18 | N20 | H24 | 177.6° | 173.8° |
| C18 | N20 | C32 | H24 | 180.0° | 180.0° |
| C18 | N20 | C32 | O33 | 0.2° | 4.6° |
| C18 | N20 | C32 | C31 | 179.8° | 175.4° |
| N20 | C18 | N8 | H20 | 6.1° | 5.4° |
| N20 | C18 | N19 | H23 | 0.0° | 5.0° |
| C14 | C17 | C34 | H22 | 180.0° | 179.8° |
| C14 | C17 | C34 | C35 | 4.8° | 0.5° |
| C17 | C14 | C15 | C16 | 1.1° | 0.2° |
| C17 | C14 | C13 | H6 | 76.1° | 29.8° |
| C17 | C14 | C13 | H7 | 165.1° | 149.7° |
| C17 | C14 | C15 | H8 | 178.9° | 179.8° |
| C14 | C17 | C34 | H16 | 175.2° | 179.7° |
| C34 | C17 | C14 | C15 | 4.5° | 0.5° |
| C17 | C34 | C35 | H16 | 180.0° | 179.7° |
| C17 | C34 | C35 | C16 | 1.8° | 0.3° |
| C17 | C34 | C35 | O36 | 177.1° | 180.0° |
| O10 | C9 | C7 | H4 | 174.9° | 119.9° |
| O10 | C9 | N11 | H21 | 178.7° | 179.9° |
| C29 | O28 | C23 | C24 | 6.1° | 0.0° |
| C29 | O28 | C23 | C22 | 174.9° | 180.0° |
| O28 | C29 | H26 | H27 | 120.0° | 120.0° |
| O28 | C29 | H26 | H28 | 120.0° | 120.0° |
| O28 | C29 | H27 | H28 | 120.0° | 120.0° |
| C14 | C15 | C16 | H8 | 180.0° | 180.0° |
| C14 | C15 | C16 | C35 | 2.0° | 0.0° |
| C14 | C15 | C16 | O37 | 179.4° | 180.0° |
| C15 | C14 | C13 | H6 | 101.7° | 150.0° |
| C15 | C14 | C13 | H7 | 17.1° | 30.0° |
| C15 | C14 | C17 | H22 | 175.6° | 179.7° |
| C34 | C35 | C16 | C15 | 1.6° | 0.0° |
| C34 | C35 | C16 | O36 | 178.9° | 179.7° |
| C34 | C35 | O36 | C39 | 0.4° | 0.0° |
| C34 | C35 | C16 | O37 | 179.1° | 179.9° |
| C35 | C34 | C17 | H22 | 175.2° | 179.7° |
| N20 | C32 | O33 | C31 | 180.0° | 180.0° |
| N20 | C32 | C31 | C25 | 131.2° | 180.0° |
| N20 | C32 | C31 | H14 | 11.3° | 60.0° |
| N20 | C32 | C31 | H15 | 109.0° | 60.0° |
| C15 | C16 | C35 | O37 | 177.5° | 180.0° |
| C15 | C16 | C35 | O36 | 179.5° | 179.7° |
| C15 | C16 | O37 | C38 | 23.7° | 0.0° |
| O28 | C23 | C24 | C22 | 178.9° | 179.9° |
| O28 | C23 | C24 | C25 | 179.7° | 179.7° |
| O28 | C23 | C22 | O27 | 2.1° | 0.1° |
| O28 | C23 | C22 | C21 | 178.2° | 180.0° |
| O28 | C23 | C24 | H10 | 0.4° | 0.0° |
| C23 | O28 | C29 | H26 | 180.0° | 179.9° |
| C23 | O28 | C29 | H27 | 60.0° | 60.0° |
| C23 | O28 | C29 | H28 | 60.0° | 59.9° |
| C16 | C35 | O36 | C39 | 178.4° | 179.7° |
| C35 | C16 | O37 | C38 | 158.8° | 180.0° |
| C35 | C16 | C15 | H8 | 178.0° | 180.0° |
| C16 | C35 | C34 | H16 | 178.2° | 180.0° |
| O36 | C35 | C16 | O37 | 2.0° | 0.3° |
| O36 | C35 | C34 | H16 | 2.9° | 0.3° |
| C35 | O36 | C39 | H32 | 180.0° | 60.0° |
| C35 | O36 | C39 | H33 | 60.0° | 60.0° |
| C35 | O36 | C39 | H34 | 60.0° | 180.0° |
| O33 | C32 | C31 | C25 | 48.8° | 0.0° |
| O33 | C32 | C31 | H14 | 168.7° | 120.0° |
| O33 | C32 | C31 | H15 | 71.0° | 120.0° |
| O33 | C32 | N20 | H24 | 179.8° | 175.4° |
| C32 | C31 | C25 | C24 | 76.5° | 90.1° |
| C32 | C31 | C25 | H14 | 119.9° | 120.0° |
| C32 | C31 | C25 | H15 | 119.8° | 119.9° |
| C32 | C31 | C25 | C26 | 103.3° | 90.2° |
| C32 | C31 | H14 | H15 | 120.4° | 120.0° |
| C31 | C32 | N20 | H24 | 0.2° | 4.6° |
| O36 | C39 | H32 | H33 | 120.0° | 120.1° |
| O36 | C39 | H32 | H34 | 120.0° | 120.0° |
| O36 | C39 | H33 | H34 | 120.0° | 120.0° |
| C23 | C24 | C25 | H10 | 180.0° | 179.7° |
| C23 | C24 | C25 | C31 | 177.4° | 180.0° |
| C23 | C24 | C25 | C26 | 2.3° | 0.3° |
| C24 | C23 | C22 | O27 | 176.8° | 180.0° |
| C24 | C23 | C22 | C21 | 0.8° | 0.1° |
| C25 | C24 | C23 | C22 | 1.4° | 0.2° |
| C24 | C25 | C31 | C26 | 179.7° | 179.7° |
| C24 | C25 | C26 | C21 | 1.0° | 0.0° |
| C24 | C25 | C31 | H14 | 43.4° | 30.0° |
| C24 | C25 | C31 | H15 | 163.7° | 150.0° |
| C24 | C25 | C26 | H25 | 179.0° | 180.0° |
| O37 | C16 | C15 | H8 | 0.6° | 0.0° |
| C16 | O37 | C38 | H29 | 180.0° | 60.0° |
| C16 | O37 | C38 | H30 | 60.0° | 60.0° |
| C16 | O37 | C38 | H31 | 60.0° | 180.0° |
| C23 | C22 | O27 | C21 | 175.9° | 179.9° |
| C23 | C22 | O27 | C30 | 179.3° | 179.9° |
| C23 | C22 | C21 | C26 | 2.2° | 0.3° |
| C23 | C22 | C21 | H9 | 177.8° | 180.0° |
| C22 | C23 | C24 | H10 | 178.5° | 180.0° |
| C31 | C25 | C26 | C21 | 178.8° | 179.7° |
| C31 | C25 | C24 | H10 | 2.6° | 0.3° |
| C25 | C31 | H14 | H15 | 120.4° | 120.0° |
| C31 | C25 | C26 | H25 | 1.2° | 0.3° |
| C25 | C26 | C21 | C22 | 1.3° | 0.3° |
| C25 | C26 | C21 | H25 | 180.0° | 180.0° |
| C25 | C26 | C21 | H9 | 178.7° | 180.0° |
| C26 | C25 | C24 | H10 | 177.6° | 180.0° |
| C26 | C25 | C31 | H14 | 136.9° | 149.7° |
| C26 | C25 | C31 | H15 | 16.6° | 29.7° |
| O37 | C38 | H29 | H30 | 120.0° | 120.0° |
| O37 | C38 | H29 | H31 | 120.0° | 120.1° |
| O37 | C38 | H30 | H31 | 120.0° | 120.1° |
| O27 | C22 | C21 | C26 | 177.9° | 179.8° |
| O27 | C22 | C21 | H9 | 2.0° | 0.1° |
| C22 | O27 | C30 | H11 | 180.0° | 60.0° |
| C22 | O27 | C30 | H12 | 60.0° | 60.0° |
| C22 | O27 | C30 | H13 | 60.0° | 179.9° |
| C21 | C22 | O27 | C30 | 3.4° | 0.0° |
| C22 | C21 | C26 | H9 | 180.0° | 179.7° |
| C22 | C21 | C26 | H25 | 178.7° | 179.7° |
| O27 | C30 | H11 | H12 | 120.0° | 120.0° |
| O27 | C30 | H11 | H13 | 120.0° | 120.0° |
| O27 | C30 | H12 | H13 | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 0.8° | 0.2° |
| H1 | C1 | C5 | H17 | 0.1° | 0.0° |
| H2 | C2 | C3 | H3 | 2.5° | 0.1° |
| H4 | C7 | C6 | H18 | 63.3° | 65.0° |
| H4 | C7 | C6 | H19 | 177.2° | 175.0° |
| H4 | C7 | N8 | H20 | 140.0° | 145.0° |
| H5 | C12 | C5 | H17 | 1.1° | 0.3° |
| H6 | C13 | N11 | H21 | 1.1° | 120.1° |
| H7 | C13 | N11 | H21 | 117.7° | 120.0° |
| H9 | C21 | C26 | H25 | 1.3° | 0.0° |
| H11 | C30 | H12 | H13 | 120.0° | 120.0° |
| H16 | C34 | C17 | H22 | 4.8° | 0.0° |
| H26 | C29 | H27 | H28 | 120.0° | 120.0° |
| H29 | C38 | H30 | H31 | 119.9° | 119.9° |
| H32 | C39 | H33 | H34 | 120.0° | 119.9° |
